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(2Z)-3-(1,3-benzodioxol-5-ylmethyl)-2-[(4-chlorophenyl)imino]-4-oxotetrahydro-2H-1,3-thiazine-6-carboxamide
SpectraBase Compound ID IqsuI6YTttJ
InChI InChI=1S/C19H16ClN3O4S/c20-12-2-4-13(5-3-12)22-19-23(17(24)8-16(28-19)18(21)25)9-11-1-6-14-15(7-11)27-10-26-14/h1-7,16H,8-10H2,(H2,21,25)/b22-19-
InChIKey OMWJZOCZOCLYCQ-QOCHGBHMSA-N
Mol Weight 417.87 g/mol
Molecular Formula C19H16ClN3O4S
Exact Mass 417.055005 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6oKexHXQitI
Name (2Z)-3-(1,3-benzodioxol-5-ylmethyl)-2-[(4-chlorophenyl)imino]-4-oxotetrahydro-2H-1,3-thiazine-6-carboxamide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C19H16ClN3O4S/c20-12-2-4-13(5-3-12)22-19-23(17(24)8-16(28-19)18(21)25)9-11-1-6-14-15(7-11)27-10-26-14/h1-7,16H,8-10H2,(H2,21,25)/b22-19-
InChIKey OMWJZOCZOCLYCQ-QOCHGBHMSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_20485
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D18662; Labnumber: MPOL-12886; SBI_ID: SBI-020489
Synonyms 3-(1,3-benzodioxol-5-ylmethyl)-2-[(4-chlorophenyl)imino]-4-oxotetrahydro-2H-1,3-thiazine-6-carboxamide
Temperature 318 °C